0473435 | lllangWV | 30 July 2023, 08:56:39 UTC | vasp parser kpath bug fix | 30 July 2023, 08:56:39 UTC |
b755f9f | lllangWV | 30 July 2023, 08:51:10 UTC | Added band structure config file | 30 July 2023, 08:51:10 UTC |
fef036f | lllangWV | 30 July 2023, 06:37:03 UTC | Added dos configuration file | 30 July 2023, 06:37:03 UTC |
33116fa | lllangWV | 30 July 2023, 04:49:48 UTC | abinit parser update. Fix pathing issue of PROCAR | 30 July 2023, 04:49:48 UTC |
c38de8a | lllangWV | 29 July 2023, 18:07:24 UTC | Update to ebs calculate_scalars_gradient | 29 July 2023, 18:07:24 UTC |
5d06270 | lllangWV | 29 July 2023, 06:30:57 UTC | Merge pull request #121 from romerogroup/main Bringing dev up to main | 29 July 2023, 06:30:57 UTC |
10395e0 | lllangWV | 29 July 2023, 06:30:38 UTC | Merge branch 'dev' into main | 29 July 2023, 06:30:38 UTC |
587abdc | lllangWV | 29 July 2023, 06:16:30 UTC | Updated to fermi3d and bandstructure2d | 29 July 2023, 06:16:30 UTC |
bcd174a | lllangWV | 28 July 2023, 08:34:20 UTC | 2d bandstructure implementation | 28 July 2023, 08:34:20 UTC |
57ac3cb | lllangWV | 27 July 2023, 06:20:06 UTC | Updated fermi3d_plot,setup, and requirements | 27 July 2023, 06:20:06 UTC |
d414fb7 | lllangWV | 26 July 2023, 06:52:06 UTC | Merge branch 'dev' into 2d_band_structure | 26 July 2023, 06:52:06 UTC |
1c94add | lllangWV | 26 July 2023, 06:35:21 UTC | Merge pull request #118 from romerogroup/fermi_surface_changes Fermi surface changes | 26 July 2023, 06:35:21 UTC |
f5e478c | lllangWV | 26 July 2023, 06:34:07 UTC | Completed fermi surface refactor | 26 July 2023, 06:34:07 UTC |
f70feb9 | lllangWV | 18 July 2023, 14:11:05 UTC | pyvista deprecation fix | 18 July 2023, 14:11:05 UTC |
8ae2ca3 | lllangWV | 18 July 2023, 13:54:58 UTC | Initial 2d band_structure push | 18 July 2023, 13:54:58 UTC |
18e33be | fvmunoz | 13 July 2023, 19:35:00 UTC | poscar_utils.py is working. It is also documented in the API-> pyposcar | 13 July 2023, 19:35:00 UTC |
832df6c | fvmunoz | 12 July 2023, 23:21:25 UTC | Enabled sphinx docs for poscar.py | 12 July 2023, 23:21:25 UTC |
a1c8522 | fvmunoz | 12 July 2023, 20:31:42 UTC | Bugfix in download_examples.py it failed to create a non-existing directory | 12 July 2023, 20:31:42 UTC |
a9c91a6 | fvmunoz | 12 July 2023, 01:14:37 UTC | Basic functionality of poscar.py added (only that file by now). | 12 July 2023, 01:14:37 UTC |
e697eac | Uthpala Herath | 11 July 2023, 19:37:22 UTC | Updated abinit.py parser to obtain xred coordinates for single atoms at origin | 11 July 2023, 19:37:22 UTC |
59be5fe | lllangWV | 09 July 2023, 16:23:23 UTC | Fermi Surface refactor | 09 July 2023, 16:23:23 UTC |
5452e8e | lllangWV | 08 July 2023, 14:43:59 UTC | abinit parser change | 08 July 2023, 14:43:59 UTC |
59ec900 | lllangWV | 07 July 2023, 13:55:28 UTC | added elk dos | 07 July 2023, 13:55:28 UTC |
131ca69 | lllangWV | 07 July 2023, 13:23:09 UTC | ebs and fermisurface3d update | 07 July 2023, 13:23:09 UTC |
bd072cd | lllangWV | 02 July 2023, 08:29:47 UTC | added abinit dos parser | 02 July 2023, 08:29:47 UTC |
fef5078 | lllangWV | 01 July 2023, 09:22:27 UTC | Add ROOT and LOGGER to utils | 01 July 2023, 09:22:27 UTC |
dcdde79 | lllangWV | 01 July 2023, 09:16:24 UTC | symmetrization method change | 01 July 2023, 09:16:24 UTC |
460fc2a | lllangWV | 01 July 2023, 06:20:58 UTC | Merge pull request #113 from romerogroup/main Updating to main | 01 July 2023, 06:20:58 UTC |
3c4cb15 | lllangWV | 01 July 2023, 06:18:51 UTC | Issue pulling with git. Nothing was wrong | 01 July 2023, 06:18:51 UTC |
8cfd9d5 | lllangWV | 01 July 2023, 06:17:48 UTC | Issue pulling with git. Nothing was wrong | 01 July 2023, 06:17:48 UTC |
3954936 | lllangWV | 01 July 2023, 06:00:54 UTC | Merge pull request #112 from romerogroup/main Pull from main | 01 July 2023, 06:00:54 UTC |
aa40dc5 | lllangWV | 01 July 2023, 05:56:04 UTC | Merge pull request #106 from romerogroup/dependabot/pip/requests-2.31.0 Bump requests from 2.28.1 to 2.31.0 | 01 July 2023, 05:56:04 UTC |
0e0d128 | lllangWV | 01 July 2023, 05:55:03 UTC | Merge pull request #105 from romerogroup/dependabot/pip/mpmath-1.3.0 Bump mpmath from 1.2.1 to 1.3.0 | 01 July 2023, 05:55:03 UTC |
dc96ff6 | fvmunoz | 30 June 2023, 22:27:20 UTC | all the files of pyposcar added ./pyposcar -> the actual code ./test/pyposcar -> test suite (run.py) It is not yet tested into pyprocar (the relative path may need some work) | 30 June 2023, 22:27:20 UTC |
6c282b7 | fvmunoz | 30 June 2023, 22:21:19 UTC | poscar.py added A lot of files are to be added, this is just a test | 30 June 2023, 22:21:19 UTC |
6c56946 | lllangWV | 24 June 2023, 08:08:48 UTC | Merge pull request #111 from romerogroup/dev pulling Dev into main | 24 June 2023, 08:08:48 UTC |
763c389 | lllangWV | 24 June 2023, 08:05:29 UTC | 2d fermi spin texture bug fix and doc update | 24 June 2023, 08:05:29 UTC |
7711a74 | lllangWV | 23 June 2023, 03:23:00 UTC | Fermi Surfaces changes | 23 June 2023, 03:23:00 UTC |
ce96d5b | lllangWV | 18 June 2023, 16:47:54 UTC | Merge pull request #110 from romerogroup/main dev update to main | 18 June 2023, 16:47:54 UTC |
ef3b254 | lllangWV | 14 June 2023, 21:17:12 UTC | doc updates | 14 June 2023, 21:17:12 UTC |
1a8b0ef | lllangWV | 14 June 2023, 20:58:14 UTC | Updated readme changelog and added notice | 14 June 2023, 20:58:14 UTC |
da9652d | lllangWV | 14 June 2023, 20:21:57 UTC | Update README.md readme update | 14 June 2023, 20:21:57 UTC |
3bd85b7 | lllangWV | 14 June 2023, 20:19:35 UTC | Updating README. Added link to older documentation | 14 June 2023, 20:19:35 UTC |
40c20c8 | lllangWV | 10 June 2023, 17:31:54 UTC | doc, .gitignore, README.md updates | 10 June 2023, 17:31:54 UTC |
7811c23 | lllangWV | 10 June 2023, 16:57:30 UTC | Updated readme for version 6.0.0 | 10 June 2023, 16:57:30 UTC |
da0365b | lllangWV | 10 June 2023, 16:48:41 UTC | doc update. | 10 June 2023, 16:48:41 UTC |
248e545 | lllangWV | 25 May 2023, 20:25:11 UTC | Update README.md Updated currently supporting codes | 25 May 2023, 20:25:11 UTC |
c10d3ac | lllangWV | 25 May 2023, 20:05:38 UTC | doc update and non-colinear update | 25 May 2023, 20:05:38 UTC |
9bd2685 | lllangWV | 23 May 2023, 19:41:30 UTC | Update to vasp non-collinear parsing | 23 May 2023, 19:41:30 UTC |
e1dc787 | lllangWV | 23 May 2023, 18:09:52 UTC | FermiSurface3D update | 23 May 2023, 18:09:52 UTC |
a1e061e | lllangWV | 23 May 2023, 14:19:56 UTC | Updated parser.py | 23 May 2023, 14:19:56 UTC |
f6b7a88 | dependabot[bot] | 23 May 2023, 05:48:52 UTC | Bump requests from 2.28.1 to 2.31.0 Bumps [requests](https://github.com/psf/requests) from 2.28.1 to 2.31.0. - [Release notes](https://github.com/psf/requests/releases) - [Changelog](https://github.com/psf/requests/blob/main/HISTORY.md) - [Commits](https://github.com/psf/requests/compare/v2.28.1...v2.31.0) --- updated-dependencies: - dependency-name: requests dependency-type: direct:production ... Signed-off-by: dependabot[bot] <support@github.com> | 23 May 2023, 05:48:52 UTC |
07f2bfc | dependabot[bot] | 22 May 2023, 16:29:23 UTC | Bump mpmath from 1.2.1 to 1.3.0 Bumps [mpmath](https://github.com/fredrik-johansson/mpmath) from 1.2.1 to 1.3.0. - [Release notes](https://github.com/fredrik-johansson/mpmath/releases) - [Changelog](https://github.com/mpmath/mpmath/blob/master/CHANGES) - [Commits](https://github.com/fredrik-johansson/mpmath/compare/1.2.1...1.3.0) --- updated-dependencies: - dependency-name: mpmath dependency-type: direct:production ... Signed-off-by: dependabot[bot] <support@github.com> | 22 May 2023, 16:29:23 UTC |
8ffabe9 | lllangWV | 16 May 2023, 14:24:14 UTC | fermi3d changes | 16 May 2023, 14:24:14 UTC |
c14d12c | lllangWV | 08 May 2023, 19:15:42 UTC | added docs | 08 May 2023, 19:15:42 UTC |
e6ba7a5 | lllangWV | 08 May 2023, 19:14:43 UTC | removed docs and add to main index.rst | 08 May 2023, 19:14:43 UTC |
9164eaf | lllangWV | 08 May 2023, 19:02:44 UTC | doc update | 08 May 2023, 19:02:44 UTC |
53bd29c | lllangWV | 08 May 2023, 18:54:29 UTC | doc updates | 08 May 2023, 18:54:29 UTC |
d8e125a | lllangWV | 08 May 2023, 14:34:47 UTC | Adding docs | 08 May 2023, 14:34:47 UTC |
69b616e | lllangWV | 08 May 2023, 14:34:07 UTC | removing docs | 08 May 2023, 14:34:07 UTC |
cb9a5ff | lllangWV | 08 May 2023, 14:21:59 UTC | doc updates | 08 May 2023, 14:21:59 UTC |
8a5fd3d | lllangWV | 08 May 2023, 14:19:08 UTC | doc updates | 08 May 2023, 14:19:08 UTC |
804782f | lllangWV | 08 May 2023, 14:17:19 UTC | doc updates | 08 May 2023, 14:17:19 UTC |
81cde72 | lllangWV | 08 May 2023, 12:21:28 UTC | Merge pull request #103 from romerogroup/dev Dev | 08 May 2023, 12:21:28 UTC |
f6f4031 | lllangWV | 08 May 2023, 12:19:07 UTC | rebase bug fix | 08 May 2023, 12:19:07 UTC |
2224d03 | lllangWV | 08 May 2023, 12:13:34 UTC | doc updates | 08 May 2023, 12:13:34 UTC |
c2ff86d | lllangWV | 08 May 2023, 11:56:46 UTC | Merge pull request #102 from romerogroup/dev Dev | 08 May 2023, 11:56:46 UTC |
1872d7c | lllangWV | 08 May 2023, 11:53:29 UTC | Updated docs and bug fixes | 08 May 2023, 11:53:29 UTC |
6fddcfb | lllangWV | 01 May 2023, 01:54:06 UTC | Merge pull request #100 from romerogroup/main Updated docs and bug fix with fermi zeroing | 01 May 2023, 01:54:06 UTC |
2a30c8c | lllangWV | 01 May 2023, 01:49:36 UTC | Updated docs and bug fix with fermi zeroing | 01 May 2023, 01:49:36 UTC |
f3a4373 | lllangWV | 30 April 2023, 20:41:16 UTC | Merge pull request #99 from romerogroup/main Making sure main and dev are up to the same commit | 30 April 2023, 20:41:16 UTC |
22ea719 | lllangWV | 30 April 2023, 20:27:02 UTC | Updated gitignore | 30 April 2023, 20:27:02 UTC |
5dc5ade | lllangWV | 30 April 2023, 20:26:12 UTC | Removed reports directory | 30 April 2023, 20:26:12 UTC |
9a00128 | lllangWV | 30 April 2023, 20:23:14 UTC | updated gitignore | 30 April 2023, 20:23:14 UTC |
21acb31 | lllangWV | 30 April 2023, 20:20:23 UTC | qe parser bug fix | 30 April 2023, 20:20:23 UTC |
e05dc84 | Pedram Tavadze | 30 April 2023, 17:30:55 UTC | Merge pull request #98 from romerogroup/dev added elk.py and code-workspace to gitignore | 30 April 2023, 17:30:55 UTC |
00b0348 | Pedram Tavadze | 30 April 2023, 17:29:45 UTC | added elk.py and code-workspace to gitignore | 30 April 2023, 17:29:45 UTC |
45bce62 | Uthpala Herath | 26 April 2023, 07:22:28 UTC | Refactored abinit parser and updated kpath module | 26 April 2023, 07:22:28 UTC |
d821010 | lllangWV | 02 April 2023, 03:39:25 UTC | Added core unit tests | 02 April 2023, 03:39:25 UTC |
443c2d1 | lllangWV | 27 March 2023, 19:38:33 UTC | bug fix | 27 March 2023, 19:38:33 UTC |
2ed0561 | lllangWV | 26 March 2023, 20:24:58 UTC | Updated ebs be able to return scalar gradients of the kpoints grid | 26 March 2023, 20:24:58 UTC |
58a7711 | lllangWV | 18 March 2023, 19:24:05 UTC | Created Parser class. all other parsers will go through this to extract ebs,dos,structure,kpath | 18 March 2023, 19:24:05 UTC |
4287f13 | lllangWV | 17 March 2023, 19:32:12 UTC | Updated abinit parser | 17 March 2023, 19:32:12 UTC |
fcc61fa | lllangWV | 17 March 2023, 15:40:14 UTC | Added pytest foundations | 17 March 2023, 15:40:14 UTC |
3d2e71d | lllangWV | 17 March 2023, 14:30:00 UTC | Added method to download development data. This is used for generating docs and testing | 17 March 2023, 14:30:00 UTC |
58772ba | lllangWV | 17 March 2023, 03:28:52 UTC | Changed examples to have the same directory pathing as downloaded data | 17 March 2023, 03:28:52 UTC |
ee772e5 | lllangWV | 17 March 2023, 00:30:08 UTC | Moved download_examples and and welcome function to utils | 17 March 2023, 00:30:08 UTC |
57aafed | lllangWV | 16 March 2023, 23:40:01 UTC | Updated download_example and tested. | 16 March 2023, 23:40:01 UTC |
d689eef | lllangWV | 16 March 2023, 19:47:49 UTC | Updated .gitignore and removed .vscode | 16 March 2023, 19:47:49 UTC |
1ce211a | lllangWV | 06 March 2023, 21:09:42 UTC | Added compare_bands example and fixed an issue in the qeparser | 06 March 2023, 21:09:42 UTC |
a782b59 | lllangWV | 06 March 2023, 15:05:14 UTC | Doc updates | 06 March 2023, 15:05:14 UTC |
422caf5 | lllangWV | 15 February 2023, 16:26:37 UTC | Added option to specify band colors in fermi 2d | 15 February 2023, 16:26:37 UTC |
2b2d5da | lllangWV | 15 February 2023, 15:05:38 UTC | Added band selection in fermi2d | 15 February 2023, 15:05:38 UTC |
a57f14c | lllangWV | 14 February 2023, 16:21:14 UTC | More doc updates | 14 February 2023, 16:21:14 UTC |
d09858c | lllangWV | 13 February 2023, 01:07:14 UTC | Added orbital projection to fermi 2d. Also added fermi2d examples | 13 February 2023, 01:07:14 UTC |
a1a390d | lllangWV | 09 February 2023, 16:02:19 UTC | Bug fix in Fermi3D | 09 February 2023, 16:02:19 UTC |
425262f | lllangWV | 09 February 2023, 12:47:24 UTC | More doc updates. Changes in IO API and add docstrings to parsers | 09 February 2023, 12:47:24 UTC |
97a82b3 | lllangWV | 06 February 2023, 19:18:27 UTC | More doc updates. A updated api. Added complete doc to core modules. | 06 February 2023, 19:18:27 UTC |
42d04d8 | lllangWV | 05 February 2023, 19:03:21 UTC | More doc changes | 05 February 2023, 19:03:21 UTC |
d117152 | lllangWV | 31 January 2023, 14:16:35 UTC | Added new sphinx _build/html to docs | 31 January 2023, 14:16:35 UTC |